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2,3,6,7-tetrakis(4'-Butylanilino)-1,4,5,8-tetraazafulvalene
SpectraBase Compound ID 2BESR8fru7U
InChI InChI=1S/C46H56N8/c1-5-9-13-33-17-25-37(26-18-33)47-41-42(48-38-27-19-34(20-28-38)14-10-6-2)52-45(51-41)46-53-43(49-39-29-21-35(22-30-39)15-11-7-3)44(54-46)50-40-31-23-36(24-32-40)16-12-8-4/h17-32H,5-16H2,1-4H3,(H,47,51)(H,48,52)(H,49,53)(H,50,54)
InChIKey LQCHXJGCNBQLFP-UHFFFAOYSA-N
Mol Weight 721.0 g/mol
Molecular Formula C46H56N8
Exact Mass 720.462794 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HBdZkcJULwp
Name 2,3,6,7-tetrakis(4'-Butylanilino)-1,4,5,8-tetraazafulvalene
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C46H56N8
InChI InChI=1S/C46H56N8/c1-5-9-13-33-17-25-37(26-18-33)47-41-42(48-38-27-19-34(20-28-38)14-10-6-2)52-45(51-41)46-53-43(49-39-29-21-35(22-30-39)15-11-7-3)44(54-46)50-40-31-23-36(24-32-40)16-12-8-4/h17-32H,5-16H2,1-4H3,(H,47,51)(H,48,52)(H,49,53)(H,50,54)
InChIKey LQCHXJGCNBQLFP-UHFFFAOYSA-N
Molecular Weight 721.010 g/mol
SMILES N(C1=NC(=C2N=C(C(=N2)Nc2ccc(cc2)CCCC)Nc2ccc(cc2)CCCC)N=C1Nc1ccc(cc1)CCCC)c1ccc(cc1)CCCC
SPLASH splash10-0229-0901000600-0dc42db7ed9a2d9f029a
Source of Spectrum U-1997-620-4
Synonyms 2-{4,5-bis[(4-butylphenyl)amino]-2H-imidazol-2-ylidene}-4-N,5-N-bis(4-butylphenyl)-2H-imidazole-4,5-diamine
Wiley ID 769611